Geometry & MOs

Info

ID:	390145
PubChem CID:	134997310
Reduced:	FOSiC13H19 (1)
Stoich.:	ABCD13E19 (1)
Weight, g/mol:	307.157229
ΔH_f, kcal/mol:	-104.15
Dipole, Da:	3.82
IP(EA), eV:	-8.81(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-benzo[b][1]benzazepin-11-ylbutanoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)O)[C@@H]2C[C@H]2[Si](C)(C)C

DOS

IR

Vibrations